SCHEMBL11423945

SCHEMBL11423945

CCOC(=O)c1ccccc1/C=N\c1cccc(C)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.53
TSHR P16473 1/20 0.51
MAPT P10636 8/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
GAA P10253 1/20 0.46
CASP3 P42574 1/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
ALDH1A1 P00352 6/20 0.46
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
HSD17B10 Q99714 1/20 0.46
PTGS2 P35354 1/20 0.45
KDM4E B2RXH2 4/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11409699 0.88 MAPT (0.48) EGFRTSHRMAPTRAB9AALDH1A1
SCHEMBL11416360 0.83 ALDH1A1 (0.55) EGFRTSHRMAPTRAB9ASMN1; SMN2
SCHEMBL14337485 0.82 MAPT (0.56) EGFRTSHRMAPTNPC1RAB9A
SCHEMBL28836848 0.77 TSHR (0.65) TSHRMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL11417706 0.76 TSHR (0.54) EGFRTSHRMAPTRAB9ASMN1; SMN2
SCHEMBL11415311 0.75 TSHR (0.53) EGFRTSHRMAPTNPC1RAB9A
SCHEMBL11409672 0.75 MAPT (0.48) MAPTGAAHTTALDH1A1MEN1
SCHEMBL11409681 0.75 MAPT (0.48) MAPTGAAHTTALDH1A1MEN1
SCHEMBL11416429 0.75 TSHR (0.53) EGFRTSHRMAPTNPC1RAB9A
SCHEMBL28242757 0.75 MAPT (0.46) MAPTNPC1RAB9ASMN1; SMN2TDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4230727-A N-BENZYLIDENEANILINE AND DERIVATIVES WILLIAM H. RORER, INC. (US) 1980-10-28 US disclosed